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Crystal structure of 2-{[5-(methylsulfanyl)-4-phenyl-4H-1,2,4-triazol-3-yl]methyl}benzo[d]thiazole
In the structure of the title compound, C(17)H(14)N(4)O(2), the triazole ring exhibits interplanar angles of 63.86 (2) and 76.96 (2)° with the phenyl and benzothiazole planes, respectively. The C—C—C angle at the methylene group is rather wide at 114.28 (4)°. The packing involves three borderlin...
| Autores principales: | , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
International Union of Crystallography
2023
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10483567/ https://www.ncbi.nlm.nih.gov/pubmed/37693680 http://dx.doi.org/10.1107/S2056989023007041 |
| _version_ | 1785102415413903360 |
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| author | Azzam, Rasha A. Elgemeie, Galal H. Elboshi, Heba A. Jones, Peter G. |
| author_facet | Azzam, Rasha A. Elgemeie, Galal H. Elboshi, Heba A. Jones, Peter G. |
| author_sort | Azzam, Rasha A. |
| collection | PubMed |
| description | In the structure of the title compound, C(17)H(14)N(4)O(2), the triazole ring exhibits interplanar angles of 63.86 (2) and 76.96 (2)° with the phenyl and benzothiazole planes, respectively. The C—C—C angle at the methylene group is rather wide at 114.28 (4)°. The packing involves three borderline C—H⋯N contacts, two of which combine to form layers parallel to ac, and a pairing of the triazole rings across an inversion centre [interplanar distance of 3.1852 (2) Å]. |
| format | Online Article Text |
| id | pubmed-10483567 |
| institution | National Center for Biotechnology Information |
| language | English |
| publishDate | 2023 |
| publisher | International Union of Crystallography |
| record_format | MEDLINE/PubMed |
| spelling | pubmed-104835672023-09-08 Crystal structure of 2-{[5-(methylsulfanyl)-4-phenyl-4H-1,2,4-triazol-3-yl]methyl}benzo[d]thiazole Azzam, Rasha A. Elgemeie, Galal H. Elboshi, Heba A. Jones, Peter G. Acta Crystallogr E Crystallogr Commun Research Communications In the structure of the title compound, C(17)H(14)N(4)O(2), the triazole ring exhibits interplanar angles of 63.86 (2) and 76.96 (2)° with the phenyl and benzothiazole planes, respectively. The C—C—C angle at the methylene group is rather wide at 114.28 (4)°. The packing involves three borderline C—H⋯N contacts, two of which combine to form layers parallel to ac, and a pairing of the triazole rings across an inversion centre [interplanar distance of 3.1852 (2) Å]. International Union of Crystallography 2023-08-23 /pmc/articles/PMC10483567/ /pubmed/37693680 http://dx.doi.org/10.1107/S2056989023007041 Text en © Azzam et al. 2023 https://creativecommons.org/licenses/by/4.0/This is an open-access article distributed under the terms of the Creative Commons Attribution (CC-BY) Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited. |
| spellingShingle | Research Communications Azzam, Rasha A. Elgemeie, Galal H. Elboshi, Heba A. Jones, Peter G. Crystal structure of 2-{[5-(methylsulfanyl)-4-phenyl-4H-1,2,4-triazol-3-yl]methyl}benzo[d]thiazole |
| title | Crystal structure of 2-{[5-(methylsulfanyl)-4-phenyl-4H-1,2,4-triazol-3-yl]methyl}benzo[d]thiazole |
| title_full | Crystal structure of 2-{[5-(methylsulfanyl)-4-phenyl-4H-1,2,4-triazol-3-yl]methyl}benzo[d]thiazole |
| title_fullStr | Crystal structure of 2-{[5-(methylsulfanyl)-4-phenyl-4H-1,2,4-triazol-3-yl]methyl}benzo[d]thiazole |
| title_full_unstemmed | Crystal structure of 2-{[5-(methylsulfanyl)-4-phenyl-4H-1,2,4-triazol-3-yl]methyl}benzo[d]thiazole |
| title_short | Crystal structure of 2-{[5-(methylsulfanyl)-4-phenyl-4H-1,2,4-triazol-3-yl]methyl}benzo[d]thiazole |
| title_sort | crystal structure of 2-{[5-(methylsulfanyl)-4-phenyl-4h-1,2,4-triazol-3-yl]methyl}benzo[d]thiazole |
| topic | Research Communications |
| url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10483567/ https://www.ncbi.nlm.nih.gov/pubmed/37693680 http://dx.doi.org/10.1107/S2056989023007041 |
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